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Information card for entry 1576075
Preview
| Coordinates | 1576075.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C24 H18 B2 F8 N10 O4 Zn |
|---|---|
| Calculated formula | C24 H18 B2 F8 N10 O4 Zn |
| Title of publication | Wrapping a single crystal spin-crossover complex with a single crystal non-spin-crossover complex to modulate the spin-transition temperature |
| Authors of publication | Fukui, Tomoya; Tsuchiya, Masahiro; Mita, Naoya; Fukushima, Takanori |
| Journal of publication | Chemical Science |
| Year of publication | 2025 |
| a | 16.9573 ± 0.0002 Å |
| b | 16.5167 ± 0.0002 Å |
| c | 10.5067 ± 0.0001 Å |
| α | 90° |
| β | 104.504 ± 0.001° |
| γ | 90° |
| Cell volume | 2848.92 ± 0.06 Å3 |
| Cell temperature | 93 ± 2 K |
| Ambient diffraction temperature | 93 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0522 |
| Residual factor for significantly intense reflections | 0.0503 |
| Weighted residual factors for significantly intense reflections | 0.1388 |
| Weighted residual factors for all reflections included in the refinement | 0.141 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.052 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 303011 (current) | 2025-10-28 | cif/ Adding structures of 1576072, 1576073, 1576074, 1576075, 1576076, 1576077 via cif-deposit CGI script. |
1576075.cif |
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Users of the data should acknowledge the original authors of the
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